Geometry & MOs

Info

ID:	195599
PubChem CID:	78708157
Reduced:	NOC12H15 (2)
Stoich.:	ABC12D15 (2)
Weight, g/mol:	330.218152
ΔH_f, kcal/mol:	-47.51
Dipole, Da:	3.73
IP(EA), eV:	-8.43(0.0)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-(cyclohexen-1-yl)ethyl-[2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl]azanium

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)NC(=O)C(C2=CC=CC=C2)NCCC3=CCCCC3

DOS

IR

Vibrations