Geometry & MOs

Info

ID:	280902
PubChem CID:	103851833
Reduced:	ON3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	249.129969
ΔH_f, kcal/mol:	-37.18
Dipole, Da:	2.06
IP(EA), eV:	-8.92(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-(2,5-dimethylthiophen-3-yl)methanamine

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)CNCC2CCCC(C2)O

DOS

IR

Vibrations