Geometry & MOs

Info

ID:	368055
PubChem CID:	127327025
Reduced:	ON3C17H17 (1)
Stoich.:	AB3C17D17 (1)
Weight, g/mol:	342.169191
ΔH_f, kcal/mol:	48.25
Dipole, Da:	7.11
IP(EA), eV:	-9.24(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-cyclopropylpyridazin-3-yl)-2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)propanamide

Drug info:

PubChemData

Smile

C1CC1C2=NN=C(C=C2)NC(=O)C3CCC4=CC=CC=C34

DOS

IR

Vibrations