Geometry & MOs

Info

ID:	59406
PubChem CID:	24855145
Reduced:	ON2C10H11 (2)
Stoich.:	AB2C10D11 (2)
Weight, g/mol:	347.163377
ΔH_f, kcal/mol:	16.4
Dipole, Da:	3.81
IP(EA), eV:	-8.58(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-3-(1-ethoxyphthalazin-6-yl)-4-methylbenzamide

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN[C@@H](C3)C4=CC=CC=C4)OC

DOS

IR

Vibrations