Geometry & MOs

Info

ID:	362948
PubChem CID:	127309954
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	287.199762
ΔH_f, kcal/mol:	-78.13
Dipole, Da:	4.62
IP(EA), eV:	-9.38(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

CC1CC2=CC=CC=C2C1NC(=O)N3CCCOCC3

DOS

IR

Vibrations