Geometry & MOs

Info

ID:	16982
PubChem CID:	481581
Reduced:	N3O4C20H27 (1)
Stoich.:	A3B4C20D27 (1)
Weight, g/mol:	373.200156
ΔH_f, kcal/mol:	-152.26
Dipole, Da:	1.84
IP(EA), eV:	-8.37(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(hydrazinecarbonyl)-4,5-dimethoxyphenyl]adamantane-1-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C(=C1)C(=O)NN)NC(=O)C23CC4CC(C2)CC(C4)C3)OC

DOS

IR

Vibrations