Geometry & MOs

Info

ID:	172408
PubChem CID:	75505477
Reduced:	N4O4H12C13 (1)
Stoich.:	A4B4C12D13 (1)
Weight, g/mol:	309.060569
ΔH_f, kcal/mol:	-3.93
Dipole, Da:	5.39
IP(EA), eV:	-8.69(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CC2=N/C(=C/3\C=CC(=CC3=O)OC)/ON2

DOS

IR

Vibrations