Geometry & MOs

Info

ID:	358237
PubChem CID:	127295782
Reduced:	FO2N3C22H30 (1)
Stoich.:	AB2C3D22E30 (1)
Weight, g/mol:	383.257277
ΔH_f, kcal/mol:	-142.12
Dipole, Da:	4.61
IP(EA), eV:	-9.4(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-cyclopentylacetyl)-N-(5-methyl-2,3-dihydro-1H-inden-1-yl)-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)CC(=O)N2CCCN(CC2)C(=O)NC3CCC4=C3C=CC(=C4)F

DOS

IR

Vibrations