Geometry & MOs

Info

ID:	134873
PubChem CID:	51773160
Reduced:	NO3C11H15 (2)
Stoich.:	AB3C11D15 (2)
Weight, g/mol:	349.200156
ΔH_f, kcal/mol:	-237.71
Dipole, Da:	2.61
IP(EA), eV:	-9.12(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[formyl(methyl)amino]-2-(4-nitrophenyl)-N-(2,4,4-trimethylpentan-2-yl)acetamide

Drug info:

PubChemData

Smile

CC(C)(C)CC(C)(C)NC(=O)[C@@H](C1=C(C=C(C=C1O)O)O)N(C)C(=O)C2=CC=CO2

DOS

IR

Vibrations