Geometry & MOs

Info

ID:	284403
PubChem CID:	104046450
Reduced:	NO3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	237.116507
ΔH_f, kcal/mol:	-95.55
Dipole, Da:	2.95
IP(EA), eV:	-9.25(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-cyclopropyl-2-[(3-fluorophenyl)methylamino]acetate

Drug info:

PubChemData

Smile

CCOCC1=CC=CC=C1CNC(C2CC2)C(=O)OC

DOS

IR

Vibrations