Geometry & MOs

Info

ID:	70119
PubChem CID:	47207904
Reduced:	SN2O2C10H12 (1)
Stoich.:	AB2C2D10E12 (1)
Weight, g/mol:	290.075885
ΔH_f, kcal/mol:	-45.33
Dipole, Da:	7.6
IP(EA), eV:	-9.18(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-[(2-propan-2-yl-1,3-thiazol-4-yl)methylsulfonyl]propanamide

Drug info:

PubChemData

Smile

CC1=CN2C=C(N=C2C=C1)CS(=O)(=O)C

DOS

IR

Vibrations