Geometry & MOs

Info

ID:	203333
PubChem CID:	79814424
Reduced:	O2N3C10H21 (1)
Stoich.:	A2B3C10D21 (1)
Weight, g/mol:	279.158292
ΔH_f, kcal/mol:	-124.95
Dipole, Da:	1.3
IP(EA), eV:	-9.63(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-ethyl-N-[2-(4-nitrophenyl)ethyl]butanamide

Drug info:

PubChemData

Smile

CCC(CC)(C(=O)NC(C)(C)C(=O)N)N

DOS

IR

Vibrations