Geometry & MOs

Info

ID:	347195
PubChem CID:	127271736
Reduced:	ClON5C19H22 (1)
Stoich.:	ABC5D19E22 (1)
Weight, g/mol:	369.216475
ΔH_f, kcal/mol:	22.67
Dipole, Da:	4.09
IP(EA), eV:	-9.24(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-1-methyl-N-(5-morpholin-4-ylpyridin-2-yl)pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)C2CCCCC2)C(=O)NCC3=CN4C=C(C=CC4=N3)Cl

DOS

IR

Vibrations