Geometry & MOs

Info

ID:	368408
PubChem CID:	127328333
Reduced:	O2N4C17H32 (1)
Stoich.:	A2B4C17D32 (1)
Weight, g/mol:	299.199762
ΔH_f, kcal/mol:	-119.3
Dipole, Da:	3.47
IP(EA), eV:	-8.05(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,7-dimethyl-1,4-diazepan-1-yl)-(4,5-dimethyl-1H-indol-2-yl)methanone

Drug info:

PubChemData

Smile

CC(CNC(=O)CNC(=O)C1CCCCC1)N2CCN(CC2)C

DOS

IR

Vibrations