Geometry & MOs

Info

ID:	208776
PubChem CID:	80584233
Reduced:	NS2C11H17 (1)
Stoich.:	AB2C11D17 (1)
Weight, g/mol:	239.145619
ΔH_f, kcal/mol:	10.51
Dipole, Da:	0.84
IP(EA), eV:	-8.63(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-propylimidazol-4-yl)methyl]-1-(thiolan-2-yl)methanamine

Drug info:

PubChemData

Smile

CC(C1=CC=CS1)NCC2CCCS2

DOS

IR

Vibrations