Geometry & MOs

Info

ID:	364417
PubChem CID:	127315656
Reduced:	ON3C13H25 (1)
Stoich.:	AB3C13D25 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	-47.58
Dipole, Da:	3.72
IP(EA), eV:	-8.66(1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,7-dimethyl-1,4-diazepan-1-yl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanone

Drug info:

PubChemData

Smile

CC1CCN(CCN1C(=O)C2CCN(C2)C)C

DOS

IR

Vibrations