Geometry & MOs

Info

ID:	291784
PubChem CID:	113492172
Reduced:	ClN2O2C13H19 (1)
Stoich.:	AB2C2D13E19 (1)
Weight, g/mol:	253.161269
ΔH_f, kcal/mol:	-93.72
Dipole, Da:	4.86
IP(EA), eV:	-8.88(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopropylpyrrolidin-3-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CC(C)C(CNCC(=O)NC1=CC=C(C=C1)Cl)O

DOS

IR

Vibrations