Geometry & MOs

Info

ID:	65062
PubChem CID:	29204414
Reduced:	IN2O2C13H17 (1)
Stoich.:	AB2C2D13E17 (1)
Weight, g/mol:	442.98006
ΔH_f, kcal/mol:	-72.42
Dipole, Da:	5.95
IP(EA), eV:	-8.81(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[2-(4-iodoanilino)-2-oxoethyl]amino]-2-oxoethyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)NCC(=O)NC1=CC=C(C=C1)I

DOS

IR

Vibrations