Geometry & MOs

Info

ID:	266793
PubChem CID:	103579460
Reduced:	BrOSN4H9C10 (1)
Stoich.:	ABCD4E9F10 (1)
Weight, g/mol:	354.01499
ΔH_f, kcal/mol:	34.37
Dipole, Da:	2.55
IP(EA), eV:	-9.65(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-bromo-2-methylpyridin-3-yl)-4-tert-butylthiadiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)Br)NC(=O)C2=C(N=NS2)C

DOS

IR

Vibrations