Geometry & MOs

Info

ID:	298492
PubChem CID:	117650206
Reduced:	N4O6C25H32 (1)
Stoich.:	A4B6C25D32 (1)
Weight, g/mol:	547.23185
ΔH_f, kcal/mol:	-171.88
Dipole, Da:	2.41
IP(EA), eV:	-8.92(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methoxyphenyl)methyl (2R)-3-[4-(indazol-1-yloxymethoxy)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)[C@@H](CC1=CC=C(C=C1)OCON2C3=C(C=CC=N3)C=N2)NC(=O)OC(C)(C)C

DOS

IR

Vibrations