Geometry & MOs

Info

ID:	134875
PubChem CID:	51773908
Reduced:	N3O4C14H19 (1)
Stoich.:	A3B4C14D19 (1)
Weight, g/mol:	293.137556
ΔH_f, kcal/mol:	-78.06
Dipole, Da:	6.92
IP(EA), eV:	-9.93(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-butyl-2-[formyl(methyl)amino]-2-(4-nitrophenyl)acetamide

Drug info:

PubChemData

Smile

CCCCNC(=O)[C@@H](C1=CC=C(C=C1)[N+](=O)[O-])N(C)C=O

DOS

IR

Vibrations