Geometry & MOs

Info

ID:	150143
PubChem CID:	53789830
Reduced:	N2O2C9H20 (1)
Stoich.:	A2B2C9D20 (1)
Weight, g/mol:	380.158786
ΔH_f, kcal/mol:	-129.76
Dipole, Da:	1.68
IP(EA), eV:	-9.85(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-ethyl-2,3-difluorophenyl) 4-(4-propylphenyl)benzoate

Drug info:

PubChemData

Smile

CCNC(=O)C(CCC(C)C)(N)O

DOS

IR

Vibrations