Geometry & MOs

Info

ID:	363397
PubChem CID:	127310934
Reduced:	SO2N3C16H27 (1)
Stoich.:	AB2C3D16E27 (1)
Weight, g/mol:	392.145302
ΔH_f, kcal/mol:	-109.99
Dipole, Da:	1.36
IP(EA), eV:	-8.49(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-thiomorpholin-4-ylcyclohexyl)methyl]-2-(1H-1,2,4-triazol-5-yl)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNC(=O)C2CCC(=O)N2)N3CCSCC3

DOS

IR

Vibrations