Geometry & MOs

Info

ID:	219529
PubChem CID:	85149109
Reduced:	N3O5C33H41 (1)
Stoich.:	A3B5C33D41 (1)
Weight, g/mol:	560.23912
ΔH_f, kcal/mol:	-150.46
Dipole, Da:	6.55
IP(EA), eV:	-9.46(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,7-dimethyloct-6-enoxy)-1,3-dimethyl-4,5-bis[3-(trifluoromethyl)phenyl]-1,3,2-diazaphospholidine

Drug info:

PubChemData

Smile

CC1CCC(C(C1)OC(=O)N2C3C(C(=O)N3C(C24CC4)C(=O)O)N(CC5=CC=CC=C5)CC6=CC=CC=C6)C(C)C

DOS

IR

Vibrations