Geometry & MOs

Info

ID:	322515
PubChem CID:	126670326
Reduced:	NC10H11 (2)
Stoich.:	AB10C11 (2)
Weight, g/mol:	325.179027
ΔH_f, kcal/mol:	60.14
Dipole, Da:	2.15
IP(EA), eV:	-7.74(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-(1-methylpiperidin-4-yl)-6,11-dihydro-5H-imidazo[2,1-b][3]benzazepine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC2=C(CC3CCC3=C(N2C)C4=CC=C(C=C4)N)C=C1

DOS

IR

Vibrations