Geometry & MOs

Info

ID:	259205
PubChem CID:	103158593
Reduced:	N3O5C11H21 (1)
Stoich.:	A3B5C11D21 (1)
Weight, g/mol:	304.062613
ΔH_f, kcal/mol:	-227.66
Dipole, Da:	6.44
IP(EA), eV:	-9.38(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-chloro-2-fluorophenyl)carbamoylamino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

CN(C)C(=O)CN(C)C(=O)NCC(CC(=O)O)OC

DOS

IR

Vibrations