Geometry & MOs

Info

ID:	358147
PubChem CID:	127295692
Reduced:	FO2N3C21H30 (1)
Stoich.:	AB2C3D21E30 (1)
Weight, g/mol:	385.272927
ΔH_f, kcal/mol:	-138.38
Dipole, Da:	2.85
IP(EA), eV:	-9.37(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-cyclopentylacetyl)-N-(2-methyl-1-phenylpropyl)-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)CC(=O)N2CCCN(CC2)C(=O)NCCC3=CC(=CC=C3)F

DOS

IR

Vibrations