Geometry & MOs

Info

ID:	1035
PubChem CID:	3696
Reduced:	N2C19H24 (1)
Stoich.:	A2B19C24 (1)
Weight, g/mol:	280.193949
ΔH_f, kcal/mol:	44.53
Dipole, Da:	2.89
IP(EA), eV:	-8.36(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine

Drug info:

PubChemData

Smile

CN(C)CCCN1C2=CC=CC=C2CCC3=CC=CC=C31

DOS

IR

Vibrations