Geometry & MOs

Info

ID:	320378
PubChem CID:	126660071
Reduced:	N3O4C24H25 (1)
Stoich.:	A3B4C24D25 (1)
Weight, g/mol:	157.110279
ΔH_f, kcal/mol:	-120.22
Dipole, Da:	1.12
IP(EA), eV:	-8.42(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(oxolan-2-yl)oxazinane

Drug info:

PubChemData

Smile

CC1=CC2=NC(=C3C(=C2C=C1)C=C(C=N3)CCC4=C(C=C(C=C4)OCC(O)(O)O)C)N

DOS

IR

Vibrations