Geometry & MOs

Info

ID:	348869
PubChem CID:	127274517
Reduced:	N2O3C13H22 (1)
Stoich.:	A2B3C13D22 (1)
Weight, g/mol:	234.136828
ΔH_f, kcal/mol:	-148.64
Dipole, Da:	5.28
IP(EA), eV:	-9.19(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-1,4-oxazepan-4-yl)-(6-methylpyridin-2-yl)methanone

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(=O)C2CCN(C(=O)C2)C

DOS

IR

Vibrations