Geometry & MOs

Info

ID:	437078
PubChem CID:	135214587
Reduced:	NC12H19 (2)
Stoich.:	AB12C19 (2)
Weight, g/mol:	376.287849
ΔH_f, kcal/mol:	-36.63
Dipole, Da:	1.69
IP(EA), eV:	-7.95(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-propan-2-yl-3-(2-propan-2-yl-1,3,4,5-tetrahydro-2-benzazepin-7-yl)-2,3,4,5-tetrahydro-1-benzazepine

Drug info:

PubChemData

Smile

CC(C)N1CCCC2=C1C=C(C=C2)CC(C)N3CCC4CCCCC4C3

DOS

IR

Vibrations