Geometry & MOs

Info

ID:	262739
PubChem CID:	103313234
Reduced:	ON3C17H25 (1)
Stoich.:	AB3C17D25 (1)
Weight, g/mol:	300.129634
ΔH_f, kcal/mol:	-33.75
Dipole, Da:	2.86
IP(EA), eV:	-8.78(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-thiophen-2-ylpropylamino)-1,3,4,5-tetrahydro-1-benzazepin-2-one

Drug info:

PubChemData

Smile

CC(CN1CCCC1)NC2CCC3=CC=CC=C3NC2=O

DOS

IR

Vibrations