Geometry & MOs

Info

ID:	354653
PubChem CID:	127287270
Reduced:	FON4C21H29 (1)
Stoich.:	ABC4D21E29 (1)
Weight, g/mol:	395.28964
ΔH_f, kcal/mol:	-79.21
Dipole, Da:	1.87
IP(EA), eV:	-8.6(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-morpholin-4-ylacetyl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1CCCC(C1)CNC(=O)N2CCC3=C(C2)C4=C(N3)C=CC(=C4)F

DOS

IR

Vibrations