Geometry & MOs

Info

ID:	43987
PubChem CID:	10322714
Reduced:	N5O5C24H37 (1)
Stoich.:	A5B5C24D37 (1)
Weight, g/mol:	475.273596
ΔH_f, kcal/mol:	-194.89
Dipole, Da:	4.97
IP(EA), eV:	-9.34(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(1H-benzimidazol-2-ylmethyl)-1'-propan-2-ylspiro[3,4-dihydroisoquinoline-1,4'-piperidine]-6-yl]benzonitrile

Drug info:

PubChemData

Smile

CC(C)[C@H](C[C@@H]([C@H](CC1=CC=CC=C1)NC(=O)OC(C)(C)C)O)C(=O)NCCC2=NOC(=N2)N

DOS

IR

Vibrations