Geometry & MOs

Info

ID:	364516
PubChem CID:	127315768
Reduced:	ON4C14H22 (1)
Stoich.:	AB4C14D22 (1)
Weight, g/mol:	274.168128
ΔH_f, kcal/mol:	-0.43
Dipole, Da:	4.5
IP(EA), eV:	-8.53(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1-benzofuran-5-yl-(4,7-dimethyl-1,4-diazepan-1-yl)methanone

Drug info:

PubChemData

Smile

CC1CCN(CCN1C(=O)C2=NNC3=C2CCC3)C

DOS

IR

Vibrations