Geometry & MOs

Info

ID:	419468
PubChem CID:	135108249
Reduced:	O4N5C20H25 (1)
Stoich.:	A4B5C20D25 (1)
Weight, g/mol:	354.115047
ΔH_f, kcal/mol:	-95.55
Dipole, Da:	4.4
IP(EA), eV:	-9.23(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2H-benzotriazol-5-yl(spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]-1'-yl)methanone

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C(=O)N3CCCC(C3)NC(=O)CCC4=CN(CCO2)N=N4

DOS

IR

Vibrations