Geometry & MOs

Info

ID:	399505
PubChem CID:	135040626
Reduced:	RbSN2H11C12 (1)
Stoich.:	ABC2D11E12 (1)
Weight, g/mol:	216.07212
ΔH_f, kcal/mol:	-4.1
Dipole, Da:	5.66
IP(EA), eV:	-7.63(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-thiophen-2-yl-5,6,7,8-tetrahydroquinazoline

Drug info:

PubChemData

Smile

C1CCC2=NC(=N[C-]=C2C1)C3=CC=CS3.[Rb+]

DOS

IR

Vibrations