Geometry & MOs

Info

ID:	275131
PubChem CID:	103813937
Reduced:	BrON3C8H10 (1)
Stoich.:	ABC3D8E10 (1)
Weight, g/mol:	271.03202
ΔH_f, kcal/mol:	-20.1
Dipole, Da:	5.85
IP(EA), eV:	-9.31(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-(6-bromopyridin-3-yl)-3-methylbutanamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CN=C(C=C1)Br)N

DOS

IR

Vibrations