Geometry & MOs

Info

ID:	335520
PubChem CID:	127254382
Reduced:	O2N5C16H23 (1)
Stoich.:	A2B5C16D23 (1)
Weight, g/mol:	255.133139
ΔH_f, kcal/mol:	-4.51
Dipole, Da:	6.23
IP(EA), eV:	-8.85(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[(2S,3S)-3-methyl-2-(tetrazol-1-yl)pentanoyl]amino]acetate

Drug info:

PubChemData

Smile

CC[C@H](C)[C@@H](C(=O)NCCC1=CC=C(C=C1)OC)N2C=NN=N2

DOS

IR

Vibrations