Geometry & MOs

Info

ID:	160536
PubChem CID:	57388969
Reduced:	OSN6C14H18 (1)
Stoich.:	ABC6D14E18 (1)
Weight, g/mol:	356.196074
ΔH_f, kcal/mol:	27.48
Dipole, Da:	2.97
IP(EA), eV:	-8.82(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-ethoxy-N-(piperidin-4-ylmethyl)-4,5-dihydro-2H-pyrazolo[4,3-h]quinazoline-3-carboxamide

Drug info:

PubChemData

Smile

CSC1=NC=C2CCC3=C(C2=N1)N(N=C3C(=O)N)CCCN

DOS

IR

Vibrations