Geometry & MOs

Info

ID:	375125
PubChem CID:	131472567
Reduced:	NSC4H4 (2)
Stoich.:	ABC4D4 (2)
Weight, g/mol:	395.85821
ΔH_f, kcal/mol:	56.56
Dipole, Da:	4.06
IP(EA), eV:	-8.43(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(bromomethyl)-5-iodo-4-(trifluoromethoxy)pyridin-3-amine

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C2=C(C=NS2)N

DOS

IR

Vibrations