Geometry & MOs

Info

ID:	361150
PubChem CID:	127302094
Reduced:	O2N3C22H31 (1)
Stoich.:	A2B3C22D31 (1)
Weight, g/mol:	385.21139
ΔH_f, kcal/mol:	-83.24
Dipole, Da:	6.26
IP(EA), eV:	-8.39(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-oxo-1,2,3-benzotriazin-3-yl)-N-[(4-piperidin-1-yloxan-4-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(NC2=C1C=C(C=C2)C(=O)NCC3(CCOCC3)N4CCCCC4)C

DOS

IR

Vibrations