Geometry & MOs

Info

ID:	354652
PubChem CID:	127287269
Reduced:	OSN5C18H31 (1)
Stoich.:	ABC5D18E31 (1)
Weight, g/mol:	372.23254
ΔH_f, kcal/mol:	-30.3
Dipole, Da:	4.33
IP(EA), eV:	-8.52(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-fluoro-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)N2CCN(CC2)C(=O)NCC3CCCN(C3)C(C)C

DOS

IR

Vibrations