Geometry & MOs

Info

ID:	363754
PubChem CID:	127313392
Reduced:	O3N4C20H34 (1)
Stoich.:	A3B4C20D34 (1)
Weight, g/mol:	371.220892
ΔH_f, kcal/mol:	-146.14
Dipole, Da:	7.15
IP(EA), eV:	-8.65(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-3,4-dihydro-2H-chromene-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCCC1C(=O)NCCN2CCN(CC2)C(=O)C3CCC3

DOS

IR

Vibrations