Geometry & MOs

Info

ID:	401616
PubChem CID:	135051837
Reduced:	NOH13C16 (1)
Stoich.:	ABC13D16 (1)
Weight, g/mol:	212.98186
ΔH_f, kcal/mol:	53.14
Dipole, Da:	2.03
IP(EA), eV:	-9.56(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

5,7-dimethylselenopheno[2,3-c]pyran-6-ium

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)CC(=O)C2=CC=CC=C2)[N+]#[C-]

DOS

IR

Vibrations