Geometry & MOs

Info

ID:	358396
PubChem CID:	127295941
Reduced:	N3O3C19H27 (1)
Stoich.:	A3B3C19D27 (1)
Weight, g/mol:	384.216141
ΔH_f, kcal/mol:	-121.36
Dipole, Da:	4.35
IP(EA), eV:	-8.98(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-cyclopentylacetyl)-N-(2-methyl-1,3-benzoxazol-6-yl)-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

CN(CC1CCCOC1)C(=O)NC2=CC=C(C=C2)C(=O)N3CCCC3

DOS

IR

Vibrations