Geometry & MOs

Info

ID:	21357
PubChem CID:	588000
Reduced:	SN3O3C16H17 (1)
Stoich.:	AB3C3D16E17 (1)
Weight, g/mol:	331.099063
ΔH_f, kcal/mol:	-70.09
Dipole, Da:	2.56
IP(EA), eV:	-9.1(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl 2-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CSC(=N1)NC(=O)C2CCCN2C(=O)OC3=CC=CC=C3

DOS

IR

Vibrations