Geometry & MOs

Info

ID:	359758
PubChem CID:	127299705
Reduced:	S2N3O4C17H25 (1)
Stoich.:	A2B3C4D17E25 (1)
Weight, g/mol:	399.128649
ΔH_f, kcal/mol:	-174.05
Dipole, Da:	5.41
IP(EA), eV:	-9.64(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-(1,1-dioxothiolan-3-yl)-2-N-methyl-2-N-(1,3-thiazol-4-ylmethyl)cyclohexane-1,2-dicarboxamide

Drug info:

PubChemData

Smile

CC1=NC=C(S1)CNC(=O)C2CCCCC2C(=O)NC3CCS(=O)(=O)C3

DOS

IR

Vibrations