Geometry & MOs

Info

ID:	82770
PubChem CID:	49856494
Reduced:	N2O9C41H54 (1)
Stoich.:	A2B9C41D54 (1)
Weight, g/mol:	246.165121
ΔH_f, kcal/mol:	-327.35
Dipole, Da:	7.32
IP(EA), eV:	-8.18(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (3R)-4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutanoate

Drug info:

Smile

C/C=C(\C)/C1=CC(=O)C2=C(O1)C3=C(C=C2C)C(=C4C(=CC(=C(C4=C3OC)O)[C@@H]5C[C@]([C@@H]([C@@H](O5)C)O)(C)N(C)C)[C@H]6C[C@H]([C@@H]([C@H](O6)C)O)N(C)C)OC

DOS

IR

Vibrations