Geometry & MOs

Info

ID:	358371
PubChem CID:	127295916
Reduced:	O2N5C18H29 (1)
Stoich.:	A2B5C18D29 (1)
Weight, g/mol:	270.194343
ΔH_f, kcal/mol:	-53.68
Dipole, Da:	4.76
IP(EA), eV:	-8.89(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl(oxan-3-ylmethyl)amino]-N-(oxolan-2-ylmethyl)acetamide

Drug info:

PubChemData

Smile

CN(CCC(=O)N1CCN(CC1)C2=NC=CC=N2)CC3CCCOC3

DOS

IR

Vibrations