Geometry & MOs

Info

ID:	363443
PubChem CID:	127311246
Reduced:	SO2N4C21H26 (1)
Stoich.:	AB2C4D21E26 (1)
Weight, g/mol:	351.252192
ΔH_f, kcal/mol:	-37.14
Dipole, Da:	4.59
IP(EA), eV:	-9.24(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(2-morpholin-4-ylethyl)-2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)C(=O)NCC2=NC(=CS2)C3=CC=NC=C3)C(=O)N4CCCC4

DOS

IR

Vibrations