Geometry & MOs

Info

ID:	397588
PubChem CID:	135030427
Reduced:	ON5C19H25 (1)
Stoich.:	AB5C19D25 (1)
Weight, g/mol:	347.192152
ΔH_f, kcal/mol:	33.65
Dipole, Da:	5.26
IP(EA), eV:	-8.78(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-tert-butyltetrazol-5-yl)-5,7-difluorospiro[1,2-dihydroindole-3,1'-cyclohexane]

Drug info:

PubChemData

Smile

C1CCC(CC1)N2C(=NN=N2)C3C4(CCOCC4)C5=CC=CC=C5N3

DOS

IR

Vibrations