Geometry & MOs

Info

ID:	70189
PubChem CID:	47211595
Reduced:	OSN2C15H16 (1)
Stoich.:	ABC2D15E16 (1)
Weight, g/mol:	268.121178
ΔH_f, kcal/mol:	24.56
Dipole, Da:	5.22
IP(EA), eV:	-9.41(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-2-oxoethyl)-N-methyl-1,2-dihydroacenaphthylene-5-carboxamide

Drug info:

PubChemData

Smile

CC1CC1CNC(=O)C2=CN=C(S2)C3=CC=CC=C3

DOS

IR

Vibrations