Geometry & MOs

Info

ID:	39460
PubChem CID:	8140883
Reduced:	N2O2C27H32 (1)
Stoich.:	A2B2C27D32 (1)
Weight, g/mol:	387.143035
ΔH_f, kcal/mol:	-81.97
Dipole, Da:	4.53
IP(EA), eV:	-8.82(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,6-dimethylanilino)-2-oxoethyl]-4,5-dimethoxy-2-nitrobenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)C23C[C@@H]4C[C@H](C2)CC(C4)(C3)C5=CC=CC=C5

DOS

IR

Vibrations