Geometry & MOs

Info

ID:

325079

PubChem CID:

126680240

Reduced:

ON2H26C46 (1)

Stoich.:

AB2C26D46 (1)

Weight, g/mol:

416.221226

ΔHf, kcal/mol:

195.21

Dipole, Da:

2.85

IP(EA), eV:

 -8.04(-1.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-[4-(1-methylazetidin-3-yl)phenyl]-2-(morpholin-4-ylmethyl)-4H-imidazo[2,1-c][1,4]benzoxazine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C4=C2C5=C(C=C4)N(C6=CC=CC=C65)C7=C8C=CC=C9C8=C(C=C7)C1=CC=CC=C19)C1=C(C=C3)OC2=CC=CC=C21

DOS

IR

Vibrations