Geometry & MOs

Info

ID:	197888
PubChem CID:	79011562
Reduced:	FNOC6H8 (2)
Stoich.:	ABCD6E8 (2)
Weight, g/mol:	260.138559
ΔH_f, kcal/mol:	-184.11
Dipole, Da:	2.52
IP(EA), eV:	-9.08(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-3-methyl-N-[2-(tetrazol-1-yl)phenyl]butanamide

Drug info:

PubChemData

Smile

CC(C)[C@H](C(=O)NC1=CC=CC=C1OC(F)F)N

DOS

IR

Vibrations