Geometry & MOs

Info

ID:	371302
PubChem CID:	127345653
Reduced:	O2N3C11H17 (1)
Stoich.:	A2B3C11D17 (1)
Weight, g/mol:	336.195011
ΔH_f, kcal/mol:	-60.36
Dipole, Da:	2.66
IP(EA), eV:	-9.12(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-adamantyl)-N-methyl-2-pyrazol-1-ylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)CC2CCOC2)C

DOS

IR

Vibrations