Geometry & MOs

Info

ID:	251456
PubChem CID:	103104060
Reduced:	FN2O3C14H17 (1)
Stoich.:	AB2C3D14E17 (1)
Weight, g/mol:	187.132077
ΔH_f, kcal/mol:	-145.62
Dipole, Da:	6.95
IP(EA), eV:	-9.37(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-amino-2-oxoethyl)-ethylamino]butanamide

Drug info:

PubChemData

Smile

CCN(CC1=C(C=C(C=C1)F)/C=C/C(=O)O)CC(=O)N

DOS

IR

Vibrations