Geometry & MOs

Info

ID:	265628
PubChem CID:	103534949
Reduced:	N2O3C10H22 (1)
Stoich.:	A2B3C10D22 (1)
Weight, g/mol:	239.071306
ΔH_f, kcal/mol:	-127.04
Dipole, Da:	1.74
IP(EA), eV:	-8.87(1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4-(3-methoxypyrrolidin-1-yl)benzaldehyde

Drug info:

PubChemData

Smile

COCC(CN1CC(C(C1)OC)OC)N

DOS

IR

Vibrations