Geometry & MOs

Info

ID:	246973
PubChem CID:	103065890
Reduced:	ClO2N3C14H20 (1)
Stoich.:	AB2C3D14E20 (1)
Weight, g/mol:	283.108754
ΔH_f, kcal/mol:	-60.12
Dipole, Da:	5.93
IP(EA), eV:	-9.18(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(chloromethyl)prop-2-enyl]-5-(3-methoxypyrrolidin-1-yl)pyridazin-3-one

Drug info:

PubChemData

Smile

CC1(CN(CCO1)C2=CC(=O)N(N=C2)CC(=C)CCl)C

DOS

IR

Vibrations