Geometry & MOs

Info

ID:	399002
PubChem CID:	135036899
Reduced:	N3O5C10H13 (1)
Stoich.:	A3B5C10D13 (1)
Weight, g/mol:	259.157229
ΔH_f, kcal/mol:	-141.17
Dipole, Da:	1.59
IP(EA), eV:	-9.79(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]propan-2-yl]indole

Drug info:

PubChemData

Smile

CC(=O)OCC1C(C(C=CO1)N=[N+]=[N-])OC(=O)C

DOS

IR

Vibrations