Geometry & MOs

Info

ID:	435301
PubChem CID:	135188265
Reduced:	FN4O6C35H37 (1)
Stoich.:	AB4C6D35E37 (1)
Weight, g/mol:	288.23006
ΔH_f, kcal/mol:	-239.35
Dipole, Da:	5.34
IP(EA), eV:	-9.46(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-propan-2-yloxypropyl 2-hexoxy-2-methylpropanoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)F)C(=O)N[C@H](C(C)C)C(=O)N2CCC3(CC2)C(=O)N(C(=O)N3C4=CC=C(C=C4)C(=O)OCC5=CC=CC=C5)C

DOS

IR

Vibrations