Geometry & MOs

Info

ID:	221865
PubChem CID:	85291469
Reduced:	SO2C16H16 (1)
Stoich.:	AB2C16D16 (1)
Weight, g/mol:	272.109568
ΔH_f, kcal/mol:	-14.95
Dipole, Da:	3.82
IP(EA), eV:	-8.85(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[4-(dimethylamino)naphthalen-1-yl]methylideneamino]thiourea

Drug info:

PubChemData

Smile

C1CC2C(C3C=C(C2O3)SC4=CC=CC=C4)C(=O)C1

DOS

IR

Vibrations