Geometry & MOs

Info

ID:	356879
PubChem CID:	127292483
Reduced:	ON2C7H14 (2)
Stoich.:	AB2C7D14 (2)
Weight, g/mol:	274.168128
ΔH_f, kcal/mol:	-106.54
Dipole, Da:	2.96
IP(EA), eV:	-8.26(1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxan-3-yl)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxamide

Drug info:

PubChemData

Smile

CC(CN1CCN(CC1)C)NC(=O)NC2CCCOC2

DOS

IR

Vibrations