Geometry & MOs

Info

ID:	34594
PubChem CID:	7978706
Reduced:	Cl2N3O3C17H19 (1)
Stoich.:	A2B3C3D17E19 (1)
Weight, g/mol:	312.183778
ΔH_f, kcal/mol:	-102.49
Dipole, Da:	7.15
IP(EA), eV:	-8.8(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-methylbenzoyl)adamantane-1-carbohydrazide

Drug info:

PubChemData

Smile

CCCCN1C(=C(C(=N1)C)C(=O)OCC(=O)NC2=CC=C(C=C2)Cl)Cl

DOS

IR

Vibrations