Geometry & MOs

Info

ID:	292894
PubChem CID:	117362616
Reduced:	NOC7H8 (2)
Stoich.:	ABC7D8 (2)
Weight, g/mol:	244.157563
ΔH_f, kcal/mol:	-46.2
Dipole, Da:	2.5
IP(EA), eV:	-9.28(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-(aminomethyl)cyclohexyl]-1H-indol-4-ol

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)CC2=NC=CN2C)C(=O)O

DOS

IR

Vibrations