Geometry & MOs

Info

ID:	345876
PubChem CID:	127270176
Reduced:	S2N3O3C18H27 (1)
Stoich.:	A2B3C3D18E27 (1)
Weight, g/mol:	367.138819
ΔH_f, kcal/mol:	-153.88
Dipole, Da:	3.98
IP(EA), eV:	-8.79(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3-thiazol-2-yl)-N-[4-(thiomorpholine-4-carbonyl)cyclohexyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(SC(=O)N1CC(=O)NC2CCC(CC2)C(=O)N3CCSCC3)C

DOS

IR

Vibrations