Geometry & MOs

Info

ID:	365402
PubChem CID:	127317801
Reduced:	ON3C14H27 (1)
Stoich.:	AB3C14D27 (1)
Weight, g/mol:	255.194677
ΔH_f, kcal/mol:	-72.39
Dipole, Da:	4.16
IP(EA), eV:	-8.53(1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,7-dimethyl-N-(oxolan-2-ylmethyl)-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCN(CCN1C(=O)NC2CCCCC2)C

DOS

IR

Vibrations