Geometry & MOs

Info

ID:	422913
PubChem CID:	135118605
Reduced:	O2N4C23H32 (1)
Stoich.:	A2B4C23D32 (1)
Weight, g/mol:	371.128821
ΔH_f, kcal/mol:	-31.99
Dipole, Da:	2.59
IP(EA), eV:	-8.36(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chlorophenyl)-(6-methoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OCCN2CCCC3(C2)CCC4=CN=C(N=C34)N(C)C)OC

DOS

IR

Vibrations