Geometry & MOs

Info

ID:	177602
PubChem CID:	76203821
Reduced:	N3O4C10H11 (1)
Stoich.:	A3B4C10D11 (1)
Weight, g/mol:	263.095771
ΔH_f, kcal/mol:	-80.38
Dipole, Da:	8.07
IP(EA), eV:	-9.82(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[cyclopropyl-[3-(2-fluorophenyl)prop-2-enoyl]amino]acetic acid

Drug info:

PubChemData

Smile

C1CC1N(CC(=O)O)C(=O)C2C=NC(=O)C=N2

DOS

IR

Vibrations