Geometry & MOs

Info

ID:	337977
PubChem CID:	127258600
Reduced:	NO6C10H17 (1)
Stoich.:	AB6C10D17 (1)
Weight, g/mol:	362.128487
ΔH_f, kcal/mol:	-244.31
Dipole, Da:	8.86
IP(EA), eV:	-10.15(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(4-chlorophenyl)methoxy]phenoxy]propyl butanoate

Drug info:

PubChemData

Smile

CCC(C(=O)N(C(C)CC(=O)O)OC)C(=O)O

DOS

IR

Vibrations