Geometry & MOs

Info

ID:	335895
PubChem CID:	127254757
Reduced:	ON6C15H18 (1)
Stoich.:	AB6C15D18 (1)
Weight, g/mol:	340.176007
ΔH_f, kcal/mol:	61.68
Dipole, Da:	5.0
IP(EA), eV:	-8.6(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-3-methyl-2-(tetrazol-1-yl)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]pentanamide

Drug info:

PubChemData

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CC[C@H](C)[C@@H](C(=O)NC1=CC=CC2=C1C=CN2)N3C=NN=N3

DOS

IR

Vibrations