Geometry & MOs

Info

ID:	34977
PubChem CID:	7979157
Reduced:	SN2O4C21H26 (1)
Stoich.:	AB2C4D21E26 (1)
Weight, g/mol:	302.108899
ΔH_f, kcal/mol:	-169.09
Dipole, Da:	6.23
IP(EA), eV:	-9.36(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N'-(4-thiophen-2-ylbutanoyl)benzohydrazide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1CCCC1)OC(=O)[C@@H]2CS[C@@]3(N2C(=O)CC3)C4=CC=CC=C4

DOS

IR

Vibrations