Geometry & MOs

Info

ID:	174065
PubChem CID:	75718048
Reduced:	ClN3O4C15H20 (1)
Stoich.:	AB3C4D15E20 (1)
Weight, g/mol:	390.288243
ΔH_f, kcal/mol:	-92.68
Dipole, Da:	6.27
IP(EA), eV:	-10.12(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-hydroxyphenyl)-2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]-N-methylhexanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations