Geometry & MOs

Info

ID:	39801
PubChem CID:	8142364
Reduced:	BrNO4C15H20 (1)
Stoich.:	ABC4D15E20 (1)
Weight, g/mol:	362.98884
ΔH_f, kcal/mol:	-152.29
Dipole, Da:	5.69
IP(EA), eV:	-9.78(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-[(2S)-2-bromopropanoyl]hydrazinyl]-2-oxoethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C[C@@H]1CCC[C@H]([C@H]1C)NC(=O)COC(=O)C2=CC=C(O2)Br

DOS

IR

Vibrations