Geometry & MOs

Info

ID:	395628
PubChem CID:	135026053
Reduced:	O7C12H22 (1)
Stoich.:	A7B12C22 (1)
Weight, g/mol:	400.251464
ΔH_f, kcal/mol:	-335.61
Dipole, Da:	4.3
IP(EA), eV:	-10.38(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3,5-bis(2-phenylethyl)pyridin-2-yl]-N-butylacetamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)/C=C/C(C([C@@H](C(CO)O)O)O)O

DOS

IR

Vibrations