Geometry & MOs

Info

ID:	146033
PubChem CID:	53625978
Reduced:	OSN4C19H26 (1)
Stoich.:	ABC4D19E26 (1)
Weight, g/mol:	441.202088
ΔH_f, kcal/mol:	-8.35
Dipole, Da:	5.39
IP(EA), eV:	-8.4(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-bis[(2-cyclopentyl-1,3-thiazol-4-yl)methyl]-2-pyrazol-1-ylethanamine

Drug info:

PubChemData

Smile

CC(=O)N1CCCCCC1C2CCN(CC2)C3=C4C=CSC4=NC=N3

DOS

IR

Vibrations