Geometry & MOs

Info

ID:	222437
PubChem CID:	85300737
Reduced:	SiC22H35 (1)
Stoich.:	AB22C35 (1)
Weight, g/mol:	229.170474
ΔH_f, kcal/mol:	13.35
Dipole, Da:	1.38
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.812557
Charge, e:	1

Chem-info

IUPAC name:

N,N-dimethyl-4-(3-pyrrolidin-1-ium-1-ylideneprop-1-enyl)aniline

Drug info:

PubChemData

Smile

CCCCCCC=C[Si](C=CCCCCCC)C1=CC=CC=C1

DOS

IR

Vibrations