Geometry & MOs

Info

ID:	196142
PubChem CID:	78788305
Reduced:	O2N3C21H31 (1)
Stoich.:	A2B3C21D31 (1)
Weight, g/mol:	280.121178
ΔH_f, kcal/mol:	-103.1
Dipole, Da:	6.01
IP(EA), eV:	-8.36(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-2-(2-hydroxyphenyl)-1,2-dihydroquinazolin-4-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)CN2CCC(CC2)C(=O)N3CCCCC3

DOS

IR

Vibrations