Geometry & MOs

Info

ID:	385115
PubChem CID:	134978347
Reduced:	PC12H17 (1)
Stoich.:	AB12C17 (1)
Weight, g/mol:	305.211981
ΔH_f, kcal/mol:	17.94
Dipole, Da:	2.14
IP(EA), eV:	-8.86(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-2-[[butan-2-yl(tert-butyl)phosphoryl]amino]-4-methylpentanoate

Drug info:

PubChemData

Smile

CC(C)(C)[P@@]1C[C@@H]1C2=CC=CC=C2

DOS

IR

Vibrations