Geometry & MOs

Info

ID:	335618
PubChem CID:	127254480
Reduced:	OSN4C19H22 (1)
Stoich.:	ABC4D19E22 (1)
Weight, g/mol:	353.196408
ΔH_f, kcal/mol:	32.42
Dipole, Da:	6.88
IP(EA), eV:	-8.23(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-3-methyl-N-[(1-methylimidazol-2-yl)-phenylmethyl]-2-(tetrazol-1-yl)pentanamide

Drug info:

PubChemData

Smile

CC1=CC=C(N1CC(=O)N2CCN(CC2)C3=NSC4=CC=CC=C43)C

DOS

IR

Vibrations