Geometry & MOs

Info

ID:	335761
PubChem CID:	127254623
Reduced:	FSO2N3C18H18 (1)
Stoich.:	ABC2D3E18F18 (1)
Weight, g/mol:	369.227709
ΔH_f, kcal/mol:	-60.42
Dipole, Da:	3.09
IP(EA), eV:	-9.15(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-N-[(1S,2S)-1-(1H-benzimidazol-2-yl)-2-methylbutyl]-3-methyl-2-(tetrazol-1-yl)pentanamide

Drug info:

PubChemData

Smile

C1COCCC1(CC(=O)NC2=NC3=C(S2)C=C(C=C3)F)N4C=CC=C4

DOS

IR

Vibrations