Geometry & MOs

Info

ID:	80325
PubChem CID:	49834049
Reduced:	N2O2C23H26 (1)
Stoich.:	A2B2C23D26 (1)
Weight, g/mol:	364.189926
ΔH_f, kcal/mol:	-36.89
Dipole, Da:	4.16
IP(EA), eV:	-8.46(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(10H-imidazo[1,2-b][2]benzazepin-4-yl)piperazin-1-yl]cyclobutane-1-carboxylic acid

Drug info:

PubChemData

Smile

C1CCN(CC1)CCCOC2=C(NC(=O)C3=CC=CC=C32)C4=CC=CC=C4

DOS

IR

Vibrations