Geometry & MOs

Info

ID:	57103
PubChem CID:	22395340
Reduced:	O2N3C30H41 (1)
Stoich.:	A2B3C30D41 (1)
Weight, g/mol:	171.068414
ΔH_f, kcal/mol:	-43.96
Dipole, Da:	7.68
IP(EA), eV:	-8.42(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,7-dihydropyrano[2,3-e]indole

Drug info:

PubChemData

Smile

CCCCCCCCCCCCOC1=CC=C(C=C1)C2C3=C(C=C(C=C3)N(C)C)OC(=C2C#N)N

DOS

IR

Vibrations