Geometry & MOs

Info

ID:	296378
PubChem CID:	117571394
Reduced:	NO2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	211.168462
ΔH_f, kcal/mol:	-51.11
Dipole, Da:	3.32
IP(EA), eV:	-8.64(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[1-(methylaminomethyl)cyclopropyl]methyl]piperazine-1-carbaldehyde

Drug info:

PubChemData

Smile

CC(=O)C1=CC(=CC=C1)NCC2(CC2)CO

DOS

IR

Vibrations