Geometry & MOs

Info

ID:	391706
PubChem CID:	135008800
Reduced:	NC18H23 (1)
Stoich.:	AB18C23 (1)
Weight, g/mol:	382.232807
ΔH_f, kcal/mol:	16.43
Dipole, Da:	1.41
IP(EA), eV:	-8.25(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-methyl-1-[2-methyl-2-[2-(4-trimethylsilylphenyl)ethynyl]cyclopropyl]prop-1-enyl] 2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

CC1=CC[C@H](C[C@H]1C2=CNC3=CC=CC=C32)C(C)C

DOS

IR

Vibrations