Geometry & MOs

Info

ID:	312309
PubChem CID:	126604230
Reduced:	NO4H15C17 (1)
Stoich.:	AB4C15D17 (1)
Weight, g/mol:	376.144137
ΔH_f, kcal/mol:	-74.76
Dipole, Da:	12.46
IP(EA), eV:	-9.15(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(5-chloro-4-ethyl-2-methylphenoxy)methyl]-3-ethoxyphenyl] propanoate

Drug info:

PubChemData

Smile

CC(=C)CN(CC#C)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)O

DOS

IR

Vibrations