Geometry & MOs

Info

ID:	342827
PubChem CID:	127265990
Reduced:	ClFON3C18H21 (1)
Stoich.:	ABCD3E18F21 (1)
Weight, g/mol:	325.215413
ΔH_f, kcal/mol:	-35.46
Dipole, Da:	4.73
IP(EA), eV:	-8.06(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-cyclopropylpyrrol-2-yl)methyl]-1-(2-methoxyphenyl)piperidin-4-amine

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CCC(CC2)NCC3=C(C(=NC=C3)Cl)F

DOS

IR

Vibrations