Geometry & MOs

Info

ID:	27115
PubChem CID:	814342
Reduced:	SO2N3C12H17 (1)
Stoich.:	AB2C3D12E17 (1)
Weight, g/mol:	335.166748
ΔH_f, kcal/mol:	-51.21
Dipole, Da:	3.33
IP(EA), eV:	-9.17(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopropylmethyl)-N-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CC1=CN=C(S1)NC(=O)CN(CC2CC2)C(=O)C

DOS

IR

Vibrations