Geometry & MOs

Info

ID:	343997
PubChem CID:	127267173
Reduced:	OF3N3C14H18 (1)
Stoich.:	AB3C3D14E18 (1)
Weight, g/mol:	287.138225
ΔH_f, kcal/mol:	-187.45
Dipole, Da:	5.76
IP(EA), eV:	-9.6(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methoxypyridazin-3-yl)-3-[2-(3-methylpyridin-4-yl)ethyl]urea

Drug info:

PubChemData

Smile

CC1=C(C=CN=C1)CCNC(=O)NC2(CCC2)C(F)(F)F

DOS

IR

Vibrations