Geometry & MOs

Info

ID:	271291
PubChem CID:	103654148
Reduced:	OS2N4C11H14 (1)
Stoich.:	AB2C4D11E14 (1)
Weight, g/mol:	356.99742
ΔH_f, kcal/mol:	19.59
Dipole, Da:	1.95
IP(EA), eV:	-8.74(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-5-iodo-N-(2-pyrazol-1-ylethyl)benzamide

Drug info:

PubChemData

Smile

CC1=C(SC(=S)N1)CC(=O)NCCN2C=CC=N2

DOS

IR

Vibrations