Geometry & MOs

Info

ID:	353041
PubChem CID:	127284191
Reduced:	N3O3C23H25 (1)
Stoich.:	A3B3C23D25 (1)
Weight, g/mol:	399.215806
ΔH_f, kcal/mol:	-56.55
Dipole, Da:	3.35
IP(EA), eV:	-8.78(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-8-[4-(3-methylpiperidine-1-carbonyl)piperidine-1-carbonyl]-4H-1,4-benzoxazin-3-one

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C1)OC(=C2)C(=O)NC3CC4(CCN(CC4)C)OC5=CC=CC=C35

DOS

IR

Vibrations