Geometry & MOs

Info

ID:	358232
PubChem CID:	127295777
Reduced:	O2N4C19H34 (1)
Stoich.:	A2B4C19D34 (1)
Weight, g/mol:	387.252192
ΔH_f, kcal/mol:	-130.63
Dipole, Da:	3.81
IP(EA), eV:	-8.71(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-cyclopentylacetyl)-N-[2-(2-methylphenoxy)ethyl]-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)CCNC(=O)N2CCC(C2)N3CCCCC3

DOS

IR

Vibrations