Geometry & MOs

Info

ID:	214739
PubChem CID:	85083505
Reduced:	N4O7C31H48 (1)
Stoich.:	A4B7C31D48 (1)
Weight, g/mol:	588.363774
ΔH_f, kcal/mol:	-297.04
Dipole, Da:	4.26
IP(EA), eV:	-8.45(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-methoxy-3-(7-oxooctadecoxy)propyl] 3,3,3-trifluoro-2-methoxy-2-phenylpropanoate

Drug info:

PubChemData

Smile

CC(=CCN(C(=NCCCCNC(=O)C=CC1=CC(=C(C=C1)OC)OC)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C

DOS

IR

Vibrations