Geometry & MOs

Info

ID:	38998
PubChem CID:	8138316
Reduced:	BrNSO3C15H20 (1)
Stoich.:	ABCD3E15F20 (1)
Weight, g/mol:	350.13789
ΔH_f, kcal/mol:	-129.93
Dipole, Da:	2.59
IP(EA), eV:	-9.27(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-naphthalen-1-yl-N-[2-oxo-2-[2-(1H-pyrrole-2-carbonyl)hydrazinyl]ethyl]acetamide

Drug info:

PubChemData

Smile

CCNC(=O)[C@@H](C)OC(=O)[C@@H](C)SCC1=CC=C(C=C1)Br

DOS

IR

Vibrations