Geometry & MOs

Info

ID:	407397
PubChem CID:	135080023
Reduced:	ClNO2H14C16 (1)
Stoich.:	ABC2D14E16 (1)
Weight, g/mol:	315.01201
ΔH_f, kcal/mol:	-44.09
Dipole, Da:	2.08
IP(EA), eV:	-9.55(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-but-2-enyl-N-(2-iodophenyl)acetamide

Drug info:

PubChemData

Smile

CC(=O)NC(C1=CC=C(C=C1)Cl)C(=O)C2=CC=CC=C2

DOS

IR

Vibrations