Geometry & MOs

Info

ID:	383066
PubChem CID:	134974573
Reduced:	NOC11H14 (2)
Stoich.:	ABC11D14 (2)
Weight, g/mol:	322.168128
ΔH_f, kcal/mol:	-57.45
Dipole, Da:	4.75
IP(EA), eV:	-8.16(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-N-naphthalen-1-yl-5-oxo-3-pyrrolidin-1-ylhex-2-enamide

Drug info:

PubChemData

Smile

CCN(CC)C1=CC(=C(C(=C1)N2CCCC2)C(=O)OC)C3=CC=CC=C3

DOS

IR

Vibrations