Geometry & MOs

Info

ID:	382729
PubChem CID:	134974054
Reduced:	BNSiO4C21H34 (1)
Stoich.:	ABCD4E21F34 (1)
Weight, g/mol:	194.094294
ΔH_f, kcal/mol:	-120.97
Dipole, Da:	3.74
IP(EA), eV:	-8.19(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,1-dimethoxyethyl)benzaldehyde

Drug info:

PubChemData

Smile

[B][C@@H]1C[C@H](N(O1)CC2=CC=CC=C2)[C@H]3[C@@H](CO[C@H](O3)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations