Geometry & MOs

Info

ID:	275117
PubChem CID:	103813898
Reduced:	BrON4C12H17 (1)
Stoich.:	ABC4D12E17 (1)
Weight, g/mol:	319.03202
ΔH_f, kcal/mol:	-20.76
Dipole, Da:	4.54
IP(EA), eV:	-9.15(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCC1N)CC(=O)NC2=CN=C(C=C2)Br

DOS

IR

Vibrations