Geometry & MOs

Info

ID:	147246
PubChem CID:	53786900
Reduced:	O2N3C21H25 (1)
Stoich.:	A2B3C21D25 (1)
Weight, g/mol:	271.053069
ΔH_f, kcal/mol:	-46.71
Dipole, Da:	5.72
IP(EA), eV:	-8.37(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-dichlorophenyl)ethenyl]-3-methylbutanamide

Drug info:

PubChemData

Smile

CCCN1C(=C(C2=C1C=CC(=C2)OC(C)(C)C(=O)N)C3=CC=NC=C3)C

DOS

IR

Vibrations