Geometry & MOs

Info

ID:	121963
PubChem CID:	50788210
Reduced:	FSO3N5H22C23 (1)
Stoich.:	ABC3D5E22F23 (1)
Weight, g/mol:	429.147075
ΔH_f, kcal/mol:	-73.5
Dipole, Da:	2.12
IP(EA), eV:	-9.18(-2.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(cyclopropylcarbamoyl)piperidine-1-carbonyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2=NN=C(S2)C(=O)NC3=CC=CC=C3)C(=O)NCC4=CC(=CC=C4)F

DOS

IR

Vibrations