Geometry & MOs

Info

ID:	351643
PubChem CID:	127280665
Reduced:	FON5C20H26 (1)
Stoich.:	ABC5D20E26 (1)
Weight, g/mol:	367.237211
ΔH_f, kcal/mol:	-48.92
Dipole, Da:	3.64
IP(EA), eV:	-8.94(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-2-[4-(6-methylquinazolin-4-yl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)CN2CCN(CC2)C3=NC=NC4=C3C(=CC=C4)F

DOS

IR

Vibrations