Geometry & MOs

Info

ID:	371935
PubChem CID:	131280954
Reduced:	BrNOC8H8 (1)
Stoich.:	ABCD8E8 (1)
Weight, g/mol:	305.96889
ΔH_f, kcal/mol:	-0.37
Dipole, Da:	4.99
IP(EA), eV:	-9.98(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-4-methoxy-5-(trifluoromethoxy)pyridine-3-sulfonyl chloride

Drug info:

PubChemData

Smile

CCC1=CC(=C(N=C1)C=O)Br

DOS

IR

Vibrations