Geometry & MOs

Info

ID:	150435
PubChem CID:	53790125
Reduced:	SN3O4H19C21 (1)
Stoich.:	AB3C4D19E21 (1)
Weight, g/mol:	193.085127
ΔH_f, kcal/mol:	-74.8
Dipole, Da:	2.53
IP(EA), eV:	-8.93(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-3-hydroxy-7-methyl-1,4-dihydroquinazolin-2-one

Drug info:

PubChemData

Smile

CC1=C(N=C(O1)C2=CC=CC=C2)CCOC3=NC=C(C=C3)CC4=C(NC(=O)S4)O

DOS

IR

Vibrations