Geometry & MOs

Info

ID:	357973
PubChem CID:	127295487
Reduced:	NOC6H7 (3)
Stoich.:	ABC6D7 (3)
Weight, g/mol:	363.252192
ΔH_f, kcal/mol:	-54.29
Dipole, Da:	8.5
IP(EA), eV:	-9.02(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-adamantylcarbamoyl)-2-[methyl(oxan-3-ylmethyl)amino]acetamide

Drug info:

PubChemData

Smile

CN(CC1CCCOC1)CC2=NC(=O)C3=C(N2)C4=CC=CC=C4O3

DOS

IR

Vibrations