Geometry & MOs

Info

ID:	431187
PubChem CID:	135171257
Reduced:	O2N4C25H28 (1)
Stoich.:	A2B4C25D28 (1)
Weight, g/mol:	379.108754
ΔH_f, kcal/mol:	0.4
Dipole, Da:	3.38
IP(EA), eV:	-9.01(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-chloro-3-[2-methyl-3-(methylamino)phenyl]phenyl]-5-formylpyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCN(C1CCCC(C1)NCC2=CC3=CC=CC=C3O2)C(=O)C4=CC5=C(N4)C=CC=N5

DOS

IR

Vibrations