Geometry & MOs

Info

ID:	180214
PubChem CID:	76599575
Reduced:	SO3N6C21H28 (1)
Stoich.:	AB3C6D21E28 (1)
Weight, g/mol:	275.224915
ΔH_f, kcal/mol:	-74.79
Dipole, Da:	6.04
IP(EA), eV:	-8.77(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2,4-dimethylcyclohex-3-en-1-yl)prop-2-enyl]-N-propylcyclopropanecarboxamide

Drug info:

PubChemData

Smile

CC1CCC2C(C1)C(=O)NC(N2)C(=O)NCC3=CC(=CC=C3)OCCSC4=NC=NN4

DOS

IR

Vibrations