Geometry & MOs

Info

ID:	34773
PubChem CID:	7978921
Reduced:	SN3O5C19H23 (1)
Stoich.:	AB3C5D19E23 (1)
Weight, g/mol:	408.187149
ΔH_f, kcal/mol:	-206.04
Dipole, Da:	3.28
IP(EA), eV:	-9.34(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-adamantyl)-N'-(2-naphthalen-2-ylsulfanylacetyl)acetohydrazide

Drug info:

PubChemData

Smile

CC(C)NC(=O)NC(=O)COC(=O)[C@H]1CS[C@]2(N1C(=O)CC2)C3=CC=CC=C3

DOS

IR

Vibrations