Geometry & MOs

Info

ID:	246449
PubChem CID:	103059684
Reduced:	ON2C14H28 (1)
Stoich.:	AB2C14D28 (1)
Weight, g/mol:	301.161269
ΔH_f, kcal/mol:	-49.25
Dipole, Da:	1.25
IP(EA), eV:	-8.5(2.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-propan-2-ylphenyl)sulfanylmethyl]-N-propylpyrazin-2-amine

Drug info:

PubChemData

Smile

CC(C)N(CC1CC1)CC2COCCC2NC

DOS

IR

Vibrations