Geometry & MOs

Info

ID:	423461
PubChem CID:	135119538
Reduced:	ON2C22H30 (1)
Stoich.:	AB2C22D30 (1)
Weight, g/mol:	394.135114
ΔH_f, kcal/mol:	-23.21
Dipole, Da:	3.61
IP(EA), eV:	-8.57(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(spiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carbonyl)thiophen-2-yl]ethanone

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2C=C1)CN3CC[C@]4(CCCN([C@@H]4C3)C)CO

DOS

IR

Vibrations