Geometry & MOs

Info

ID:	310822
PubChem CID:	126587878
Reduced:	N2O2C21H28 (1)
Stoich.:	A2B2C21D28 (1)
Weight, g/mol:	332.142387
ΔH_f, kcal/mol:	-74.36
Dipole, Da:	2.55
IP(EA), eV:	-8.16(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[2-[(4-ethyl-2-fluorophenoxy)methyl]-3-methoxyphenyl]acetate

Drug info:

PubChemData

Smile

CCC1=C(C(=CC=C1)NC(=O)NC)COC2=CC(=C(C=C2C)CC)C

DOS

IR

Vibrations