Geometry & MOs

Info

ID:	142659
PubChem CID:	53072249
Reduced:	SO3N4C23H24 (1)
Stoich.:	AB3C4D23E24 (1)
Weight, g/mol:	364.076075
ΔH_f, kcal/mol:	-41.28
Dipole, Da:	7.29
IP(EA), eV:	-8.46(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-5-(1-propanoylpyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)C3CCCN3C(=O)COC4=CC=CC(=C4)C

DOS

IR

Vibrations