Geometry & MOs

Info

ID:	421293
PubChem CID:	135115731
Reduced:	N4O4C23H30 (1)
Stoich.:	A4B4C23D30 (1)
Weight, g/mol:	375.194677
ΔH_f, kcal/mol:	-116.25
Dipole, Da:	5.12
IP(EA), eV:	-8.69(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methoxy-1'-(4-methylphthalazin-1-yl)spiro[3,4-dihydroisochromene-1,4'-piperidine]

Drug info:

PubChemData

Smile

CC(C)C[C@@H]1C(=O)NCCNCC2=CC(=C(C(=C2)OC)OC)C3=CC(=CN=C3)C(=O)N1

DOS

IR

Vibrations