Geometry & MOs

Info

ID:	426711
PubChem CID:	135153501
Reduced:	ClOSF2N3H10C12 (1)
Stoich.:	ABCD2E3F10G12 (1)
Weight, g/mol:	305.961223
ΔH_f, kcal/mol:	-68.65
Dipole, Da:	3.22
IP(EA), eV:	-9.68(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-chloropyridin-3-yl)-4-(difluoromethyl)thiadiazole-5-carbothioamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Cl)N(C)C(=O)C2=C(N=NS2)C(F)F

DOS

IR

Vibrations