Geometry & MOs

Info

ID:	34985
PubChem CID:	7979165
Reduced:	SN2O4C20H24 (1)
Stoich.:	AB2C4D20E24 (1)
Weight, g/mol:	291.158292
ΔH_f, kcal/mol:	-153.0
Dipole, Da:	4.2
IP(EA), eV:	-9.2(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-3-methyl-1-[2-(4-methylbenzoyl)hydrazinyl]-1-oxobutan-2-yl]acetamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N1CCCC1)OC(=O)[C@H]2CS[C@@]3(N2C(=O)CC3)C4=CC=CC=C4

DOS

IR

Vibrations