Geometry & MOs

Info

ID:	296405
PubChem CID:	117571916
Reduced:	ClN2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	220.121178
ΔH_f, kcal/mol:	10.64
Dipole, Da:	5.99
IP(EA), eV:	-8.16(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(pyridin-4-ylmethylamino)methyl]cyclobutane-1-carboxylic acid

Drug info:

PubChemData

Smile

CNCC1(CCC1)CNC2=CC(=CC=C2)Cl

DOS

IR

Vibrations