Geometry & MOs

Info

ID:	149881
PubChem CID:	53789561
Reduced:	ON2C30H52 (1)
Stoich.:	AB2C30D52 (1)
Weight, g/mol:	390.183109
ΔH_f, kcal/mol:	-69.85
Dipole, Da:	4.64
IP(EA), eV:	-8.64(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methylphenyl) 2-butoxy-6-phenylmethoxybenzoate

Drug info:

PubChemData

Smile

CCCCN1CCN(CC1C(=O)C)CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C

DOS

IR

Vibrations