Geometry & MOs

Info

ID:	37776
PubChem CID:	8024299
Reduced:	N2O3C12H12 (1)
Stoich.:	A2B3C12D12 (1)
Weight, g/mol:	300.183778
ΔH_f, kcal/mol:	-48.09
Dipole, Da:	2.25
IP(EA), eV:	-9.59(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R)-2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]indole-3-carbaldehyde

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NC(=O)C2=CC=C(C=C2)CO

DOS

IR

Vibrations