Geometry & MOs

Info

ID:	350060
PubChem CID:	127276933
Reduced:	N3O3C23H33 (1)
Stoich.:	A3B3C23D33 (1)
Weight, g/mol:	396.252526
ΔH_f, kcal/mol:	-101.14
Dipole, Da:	3.37
IP(EA), eV:	-8.78(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-1-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)ethanone

Drug info:

PubChemData

Smile

CC(C1=CC2=CC=CC=C2O1)NC(=O)C(C)N3CCC(CC3)CN4CCOCC4

DOS

IR

Vibrations