Geometry & MOs

Info

ID:	20605
PubChem CID:	584817
Reduced:	NOC19H25 (1)
Stoich.:	ABC19D25 (1)
Weight, g/mol:	283.193614
ΔH_f, kcal/mol:	-65.72
Dipole, Da:	4.06
IP(EA), eV:	-8.38(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-dimethylphenyl)adamantane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)C3)C

DOS

IR

Vibrations