Geometry & MOs

Info

ID:	43633
PubChem CID:	10321571
Reduced:	O3N5H21C26 (1)
Stoich.:	A3B5C21D26 (1)
Weight, g/mol:	451.220617
ΔH_f, kcal/mol:	31.44
Dipole, Da:	4.61
IP(EA), eV:	-8.96(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (4R,5S)-5-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-4-phenylmethoxypentanoate

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C#N)COC2=CC=C(C=C2)OC3=NC=C(C=C3)C(=O)NCC4=CC(=NC=C4)N

DOS

IR

Vibrations