Geometry & MOs

Info

ID:	136014
PubChem CID:	51965805
Reduced:	ClSO2N3H20C21 (1)
Stoich.:	ABC2D3E20F21 (1)
Weight, g/mol:	415.135448
ΔH_f, kcal/mol:	-16.73
Dipole, Da:	4.34
IP(EA), eV:	-9.27(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6S)-2-phenyl-5,6,7,8-tetrahydroquinazolin-6-yl]naphthalene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Cl)S(=O)(=O)N[C@H]2CCC3=NC(=NC=C3C2)C4=CC=CC=C4

DOS

IR

Vibrations