Geometry & MOs

Info

ID:	204060
PubChem CID:	79907032
Reduced:	OSN3C15H23 (1)
Stoich.:	ABC3D15E23 (1)
Weight, g/mol:	288.220164
ΔH_f, kcal/mol:	6.97
Dipole, Da:	2.82
IP(EA), eV:	-8.52(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-propan-2-yloxyethyl)spiro[4,5-dihydro-2H-1,4-benzodiazepine-3,1'-cyclopentane]

Drug info:

PubChemData

Smile

C1CC1NCC2=NN(C=C2)C3CCOC4(C3)CCSC4

DOS

IR

Vibrations