Geometry & MOs

Info

ID:	337935
PubChem CID:	127258558
Reduced:	PO6C23H23 (1)
Stoich.:	AB6C23D23 (1)
Weight, g/mol:	299.152144
ΔH_f, kcal/mol:	-253.82
Dipole, Da:	3.12
IP(EA), eV:	-9.48(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(phenylmethoxyamino)phenyl]methyl butanoate

Drug info:

PubChemData

Smile

CCCC(=O)OCC1=CC(=CC=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3

DOS

IR

Vibrations