Geometry & MOs

Info

ID:	79951
PubChem CID:	49831731
Reduced:	SiO2C16H29 (2)
Stoich.:	AB2C16D29 (2)
Weight, g/mol:	356.198759
ΔH_f, kcal/mol:	-275.2
Dipole, Da:	2.24
IP(EA), eV:	-9.11(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,3R)-1-(3,4-dimethoxyphenyl)-7-(4-methoxyphenyl)hept-6-en-3-ol

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)OCCCCC#C[C@H]([C@@H](C)[C@@H]([C@@H](C)COCC1=CC=CC=C1)O[Si](CC)(CC)CC)O

DOS

IR

Vibrations