Geometry & MOs

Info

ID:	353073
PubChem CID:	127284223
Reduced:	SO2N3C21H27 (1)
Stoich.:	AB2C3D21E27 (1)
Weight, g/mol:	389.188546
ΔH_f, kcal/mol:	-40.8
Dipole, Da:	5.35
IP(EA), eV:	-8.6(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-1-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2(CCCC2)C(=O)NC3=NC(=CS3)CN4CCOCC4

DOS

IR

Vibrations