Geometry & MOs

Info

ID:	20332
PubChem CID:	583157
Reduced:	NOC12H15 (1)
Stoich.:	ABC12D15 (1)
Weight, g/mol:	189.115364
ΔH_f, kcal/mol:	-33.37
Dipole, Da:	1.91
IP(EA), eV:	-8.41(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4a-methyl-3,4,9,9a-tetrahydro-2H-pyrano[2,3-b]indole

Drug info:

PubChemData

Smile

CC12CCCOC1NC3=CC=CC=C23

DOS

IR

Vibrations