Geometry & MOs

Info

ID:	415509
PubChem CID:	135088505
Reduced:	O2N4C17H26 (1)
Stoich.:	A2B4C17D26 (1)
Weight, g/mol:	340.178693
ΔH_f, kcal/mol:	-64.82
Dipole, Da:	2.76
IP(EA), eV:	-9.16(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8-methoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)-(1-methylpyrrol-2-yl)methanone

Drug info:

PubChemData

Smile

CCC1=NC=C(C=N1)C(=O)N2CC[C@]3(CCCN([C@@H]3C2)C)CO

DOS

IR

Vibrations