Geometry & MOs

Info

ID:	336241
PubChem CID:	127255248
Reduced:	SO3N4H14C18 (1)
Stoich.:	AB3C4D14E18 (1)
Weight, g/mol:	370.191738
ΔH_f, kcal/mol:	3.48
Dipole, Da:	5.38
IP(EA), eV:	-8.34(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-N-(6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-3-methyl-2-(tetrazol-1-yl)pentanamide

Drug info:

PubChemData

Smile

COC1=CNC(=CC1=O)C(=O)NC2=NC(=CS2)C3=CNC4=CC=CC=C43

DOS

IR

Vibrations