Geometry & MOs

Info

ID:	375747
PubChem CID:	134221737
Reduced:	NP2O21C27H55 (1)
Stoich.:	AB2C21D27E55 (1)
Weight, g/mol:	210.093918
ΔH_f, kcal/mol:	-1037.28
Dipole, Da:	4.02
IP(EA), eV:	-9.67(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-1,3-bis[(Z)-2-(methylideneamino)ethenyl]thiourea

Drug info:

PubChemData

Smile

COC1C(C(OC1OCC(C(C(COP(O)OC2C(OC(C2OC)OCC(C(C(CO)O)O)O)CO)O)O)O)CO)OP(O)OCCCCCN

DOS

IR

Vibrations