Geometry & MOs

Info

ID:	360528
PubChem CID:	127301173
Reduced:	ON2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	377.267842
ΔH_f, kcal/mol:	-38.26
Dipole, Da:	4.82
IP(EA), eV:	-8.84(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-3-[4-(oxolane-2-carbonyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C1CC2CCC1C2)NC(=O)CCN3C(=O)N4C=CC=CC4=N3

DOS

IR

Vibrations