Geometry & MOs

Info

ID:	39904
PubChem CID:	8143176
Reduced:	O3N5C19H27 (1)
Stoich.:	A3B5C19D27 (1)
Weight, g/mol:	336.220164
ΔH_f, kcal/mol:	-106.42
Dipole, Da:	8.87
IP(EA), eV:	-8.93(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-[(2S)-3-(4-tert-butylphenyl)-2-methylpropylidene]amino]-2-phenylacetamide

Drug info:

PubChemData

Smile

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NCC(=O)NCC

DOS

IR

Vibrations