Geometry & MOs

Info

ID:	69436
PubChem CID:	47170064
Reduced:	NO3C16H19 (1)
Stoich.:	AB3C16D19 (1)
Weight, g/mol:	270.173213
ΔH_f, kcal/mol:	-82.1
Dipole, Da:	5.39
IP(EA), eV:	-9.25(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-adamantyl)-N-methylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(O1)C(=O)NCC2=CC=CC=C2COC

DOS

IR

Vibrations