Geometry & MOs

Info

ID:	358271
PubChem CID:	127295816
Reduced:	N3O3C17H31 (1)
Stoich.:	A3B3C17D31 (1)
Weight, g/mol:	365.267842
ΔH_f, kcal/mol:	-161.73
Dipole, Da:	7.74
IP(EA), eV:	-9.11(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-cyclopentylacetyl)-N-[1-(oxolan-2-yl)propan-2-yl]-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCCCN1C(=O)C(C)NC(=O)N(C)CC2CCCOC2

DOS

IR

Vibrations