Geometry & MOs

Info

ID:	275123
PubChem CID:	103813919
Reduced:	BrON3C10H14 (1)
Stoich.:	ABC3D10E14 (1)
Weight, g/mol:	243.00072
ΔH_f, kcal/mol:	-29.58
Dipole, Da:	5.73
IP(EA), eV:	-9.3(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-(6-bromopyridin-3-yl)propanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations