Geometry & MOs

Info

ID:	365722
PubChem CID:	127318447
Reduced:	N2O4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	357.205242
ΔH_f, kcal/mol:	-149.05
Dipole, Da:	4.91
IP(EA), eV:	-8.78(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(4-methylpiperazine-1-carbonyl)phenyl]methyl]-7-oxabicyclo[2.2.1]heptane-2-carboxamide

Drug info:

PubChemData

Smile

C1CC2C(CC1O2)C(=O)NC3=CC=C(C=C3)CC(=O)N4CCOCC4

DOS

IR

Vibrations