Geometry & MOs

Info

ID:	138496
PubChem CID:	52374602
Reduced:	Cl2N2O3H12C18 (1)
Stoich.:	A2B2C3D12E18 (1)
Weight, g/mol:	310.142976
ΔH_f, kcal/mol:	-36.29
Dipole, Da:	5.99
IP(EA), eV:	-9.19(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(cyclopropylcarbamoylamino)-N-(5-methylpyridin-2-yl)benzamide

Drug info:

PubChemData

Smile

C1COC2=C(C=CC=C2O1)/C=C(/C#N)\C(=O)NC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations