Geometry & MOs

Info

ID:	295219
PubChem CID:	117521998
Reduced:	BrN5C7H10 (1)
Stoich.:	AB5C7D10 (1)
Weight, g/mol:	220.040341
ΔH_f, kcal/mol:	74.81
Dipole, Da:	6.83
IP(EA), eV:	-8.81(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-4-(2-chlorophenyl)-1H-pyridin-2-one

Drug info:

PubChemData

Smile

CC1=NN2C(=C(N=C2N1C)CN)Br

DOS

IR

Vibrations