Geometry & MOs

Info

ID:	174062
PubChem CID:	75717756
Reduced:	N3O4C20H27 (1)
Stoich.:	A3B4C20D27 (1)
Weight, g/mol:	310.262028
ΔH_f, kcal/mol:	-94.06
Dipole, Da:	8.67
IP(EA), eV:	-9.58(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[butanoyl(methyl)amino]-N-cyclohexyl-3-ethylpentanamide

Drug info:

PubChemData

Smile

CC(=CC(=O)N(C)C(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)NC2CCCCC2)C

DOS

IR

Vibrations