Geometry & MOs

Info

ID:	359296
PubChem CID:	127298228
Reduced:	ON2C8H13 (2)
Stoich.:	AB2C8D13 (2)
Weight, g/mol:	386.268176
ΔH_f, kcal/mol:	-62.41
Dipole, Da:	1.63
IP(EA), eV:	-8.62(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethyl-N-[1-(2-morpholin-4-ylethyl)pyrazol-3-yl]adamantane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)NC2=NN(C=C2)CCN3CCOCC3

DOS

IR

Vibrations