Geometry & MOs

Info

ID:	271394
PubChem CID:	103673824
Reduced:	N4C15H28 (1)
Stoich.:	A4B15C28 (1)
Weight, g/mol:	269.075346
ΔH_f, kcal/mol:	9.06
Dipole, Da:	1.8
IP(EA), eV:	-8.53(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chlorothiophen-2-yl)-N-[(1-propylpyrazol-4-yl)methyl]methanamine

Drug info:

PubChemData

Smile

CCCN1C=C(C=N1)CNC2CCN(CC2)C(C)C

DOS

IR

Vibrations