Geometry & MOs

Info

ID:	284397
PubChem CID:	104046434
Reduced:	NO2C14H15 (1)
Stoich.:	AB2C14D15 (1)
Weight, g/mol:	289.092578
ΔH_f, kcal/mol:	6.96
Dipole, Da:	2.25
IP(EA), eV:	-8.73(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-cyclopropyl-2-[3-(trifluoromethoxy)anilino]acetate

Drug info:

PubChemData

Smile

COC(=O)C(C1CC1)NC2=CC=CC(=C2)C#C

DOS

IR

Vibrations