Geometry & MOs

Info

ID:	357889
PubChem CID:	127295389
Reduced:	O2N3C22H39 (1)
Stoich.:	A2B3C22D39 (1)
Weight, g/mol:	379.207133
ΔH_f, kcal/mol:	-137.6
Dipole, Da:	3.69
IP(EA), eV:	-9.25(1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-cyclopentylacetyl)-1,4-diazepan-1-yl]-N-(3,4-difluorophenyl)acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NCC1CCCCC1)N2CCCN(CC2)C(=O)CC3CCCC3

DOS

IR

Vibrations