Geometry & MOs

Info

ID:	346240
PubChem CID:	127270744
Reduced:	OS2N6C15H18 (1)
Stoich.:	AB2C6D15E18 (1)
Weight, g/mol:	318.140199
ΔH_f, kcal/mol:	100.83
Dipole, Da:	6.68
IP(EA), eV:	-8.67(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopropylcarbamoyl)-2-(1,2,3,4-tetrahydronaphthalen-1-ylsulfanyl)propanamide

Drug info:

PubChemData

Smile

C1CC1N2C(=NN=C2SCC3=CN4C=CSC4=N3)N5CCOCC5

DOS

IR

Vibrations