Geometry & MOs

Info

ID:	10546
PubChem CID:	104037
Reduced:	NOC11H13 (1)
Stoich.:	ABC11D13 (1)
Weight, g/mol:	175.099714
ΔH_f, kcal/mol:	-10.59
Dipole, Da:	7.2
IP(EA), eV:	-8.27(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-pyrrolidin-1-ylbenzaldehyde

Drug info:

PubChemData

Smile

C1CCN(C1)C2=CC=C(C=C2)C=O

DOS

IR

Vibrations