Geometry & MOs

Info

ID:	43954
PubChem CID:	10322395
Reduced:	SN4O6C21H32 (1)
Stoich.:	AB4C6D21E32 (1)
Weight, g/mol:	468.257692
ΔH_f, kcal/mol:	-255.3
Dipole, Da:	5.84
IP(EA), eV:	-9.0(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1'-[4-[1-(4-fluorophenyl)indol-3-yl]butyl]-6-methylspiro[1H-2-benzofuran-3,4'-piperidine]

Drug info:

PubChemData

Smile

C[C@H]([C@@H](C(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS(=O)C)NC(=O)C1=CC=CC=C1)O

DOS

IR

Vibrations