Geometry & MOs

Info

ID:	61333
PubChem CID:	26708236
Reduced:	SN3O4C19H19 (1)
Stoich.:	AB3C4D19E19 (1)
Weight, g/mol:	380.119464
ΔH_f, kcal/mol:	-126.4
Dipole, Da:	6.84
IP(EA), eV:	-9.1(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 4-[(2-methyl-4-phenyl-1,3-thiazole-5-carbonyl)amino]benzoate

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)NC3=CC=C(C=C3)C(=O)OC(C)C

DOS

IR

Vibrations