Geometry & MOs

Info

ID:	353544
PubChem CID:	127285121
Reduced:	SO2N6C14H20 (1)
Stoich.:	AB2C6D14E20 (1)
Weight, g/mol:	379.283492
ΔH_f, kcal/mol:	-1.66
Dipole, Da:	2.85
IP(EA), eV:	-8.89(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclopentanecarbonylamino)-N-(3-morpholin-4-ylbutan-2-yl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C(C)N1CCOCC1)NC(=O)C2=CSC(=N2)C3=NC=NN3

DOS

IR

Vibrations