Geometry & MOs

Info

ID:	121181
PubChem CID:	50758014
Reduced:	O2N3C20H29 (1)
Stoich.:	A2B3C20D29 (1)
Weight, g/mol:	318.194343
ΔH_f, kcal/mol:	-74.91
Dipole, Da:	4.39
IP(EA), eV:	-8.69(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methoxypropyl)-2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)butanamide

Drug info:

PubChemData

Smile

CCC(C(=O)N1CCN(CC1)CC)N2C(=O)CCCC3=CC=CC=C32

DOS

IR

Vibrations