Geometry & MOs

Info

ID:	251178
PubChem CID:	103101987
Reduced:	O2N3C12H21 (1)
Stoich.:	A2B3C12D21 (1)
Weight, g/mol:	239.107005
ΔH_f, kcal/mol:	-101.38
Dipole, Da:	3.64
IP(EA), eV:	-9.59(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-(2-amino-2-oxoethyl)-N-ethyl-3-fluorobenzamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)C1C2CCC(C2)C1N

DOS

IR

Vibrations