Geometry & MOs

Info

ID:	186590
PubChem CID:	77450346
Reduced:	O3C13H16 (1)
Stoich.:	A3B13C16 (1)
Weight, g/mol:	541.291688
ΔH_f, kcal/mol:	-120.97
Dipole, Da:	4.76
IP(EA), eV:	-9.05(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[[1-[2-(cyclopentyloxycarbonylamino)-3,3-dimethylbutanoyl]pyrrolidine-2-carbonyl]amino]-2-ethenylcyclopropyl]-(2-hydroxy-2-methylpropyl)phosphinic acid

Drug info:

PubChemData

Smile

C1CC(CC(C1)OC2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations