Geometry & MOs

Info

ID:	335747
PubChem CID:	127254609
Reduced:	N3O3H17C20 (1)
Stoich.:	A3B3C17D20 (1)
Weight, g/mol:	323.116444
ΔH_f, kcal/mol:	-43.82
Dipole, Da:	1.31
IP(EA), eV:	-9.33(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-3-methyl-2-(tetrazol-1-yl)pentanamide

Drug info:

PubChemData

Smile

C=CCNC(=O)CN1C2C3=CC=CC=C3C(=O)N2C4=CC=CC=C4C1=O

DOS

IR

Vibrations