Geometry & MOs

Info

ID:	69768
PubChem CID:	47205356
Reduced:	S2N3O4C11H13 (1)
Stoich.:	A2B3C4D11E13 (1)
Weight, g/mol:	304.028456
ΔH_f, kcal/mol:	-75.35
Dipole, Da:	4.59
IP(EA), eV:	-9.64(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N'-(2-methylsulfonylpropanoyl)benzohydrazide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C(=O)NCCC2=CC=C(S2)S(=O)(=O)N

DOS

IR

Vibrations