Geometry & MOs

Info

ID:	35537
PubChem CID:	7980004
Reduced:	SN2O2C20H24 (1)
Stoich.:	AB2C2D20E24 (1)
Weight, g/mol:	333.205242
ΔH_f, kcal/mol:	-39.15
Dipole, Da:	2.14
IP(EA), eV:	-8.79(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=C(C=C2)CSC

DOS

IR

Vibrations