Geometry & MOs

Info

ID:	276226
PubChem CID:	103821379
Reduced:	BrFNO3H9C10 (1)
Stoich.:	ABCD3E9F10 (1)
Weight, g/mol:	285.088019
ΔH_f, kcal/mol:	-157.07
Dipole, Da:	7.39
IP(EA), eV:	-10.09(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-[3-(cyclopropylmethoxy)propyl]-3-nitropyridin-2-amine

Drug info:

PubChemData

Smile

C[C@@H](C(=O)O)NC(=O)C1=C(C=CC=C1Br)F

DOS

IR

Vibrations