Geometry & MOs

Info

ID:	402165
PubChem CID:	135054704
Reduced:	N2O3H22C24 (1)
Stoich.:	A2B3C22D24 (1)
Weight, g/mol:	530.18518
ΔH_f, kcal/mol:	-37.16
Dipole, Da:	4.37
IP(EA), eV:	-9.62(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (Z,2R,3S)-2-(4-bromophenyl)-3-methyl-5-phenyl-5-tri(propan-2-yl)silyloxypent-4-enoate

Drug info:

PubChemData

Smile

COC(=O)/N=C(/C[C@@H](C1=CC=CC=C1)NC(=O)C2=CC=CC=C2)\C3=CC=CC=C3

DOS

IR

Vibrations