Geometry & MOs

Info

ID:	317907
PubChem CID:	126647546
Reduced:	O5C43H64 (1)
Stoich.:	A5B43C64 (1)
Weight, g/mol:	341.175595
ΔH_f, kcal/mol:	-278.78
Dipole, Da:	8.2
IP(EA), eV:	-8.75(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 2-[[tert-butyl(phenoxy)phosphoryl]amino]-2-methylpropanoate

Drug info:

PubChemData

Smile

CCCCCC1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)OCC(CC)CCCCC(CC)COC(=O)C(CC(C)(C)C)C(C)(C)C)OC2=O

DOS

IR

Vibrations