Geometry & MOs

Info

ID:	156237
PubChem CID:	56369771
Reduced:	FON5C19H22 (1)
Stoich.:	ABC5D19E22 (1)
Weight, g/mol:	396.98288
ΔH_f, kcal/mol:	-9.36
Dipole, Da:	3.74
IP(EA), eV:	-8.73(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[4-[(5-bromo-2-chloropyridine-3-carbonyl)amino]phenyl]-N-methylcarbamate

Drug info:

PubChemData

Smile

CCC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NC3=NNC(=C3)C(C)(C)C

DOS

IR

Vibrations