Geometry & MOs

Info

ID:	339628
PubChem CID:	127261618
Reduced:	SN4C11H16 (1)
Stoich.:	AB4C11D16 (1)
Weight, g/mol:	219.046633
ΔH_f, kcal/mol:	48.21
Dipole, Da:	6.38
IP(EA), eV:	-8.58(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-chromen-2-ylideneamino]thiourea

Drug info:

PubChemData

Smile

CC(C)(/C(=N/NC(=S)N)/C1=CC=CC=C1)N

DOS

IR

Vibrations