Geometry & MOs

Info

ID:	34994
PubChem CID:	7979175
Reduced:	SN3O5C18H21 (1)
Stoich.:	AB3C5D18E21 (1)
Weight, g/mol:	346.098728
ΔH_f, kcal/mol:	-197.36
Dipole, Da:	3.13
IP(EA), eV:	-9.31(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[3-(benzenesulfonyl)propanoyl]-4-methylbenzohydrazide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC(=O)NC)OC(=O)[C@H]1CS[C@@]2(N1C(=O)CC2)C3=CC=CC=C3

DOS

IR

Vibrations