Geometry & MOs

Info

ID:	195440
PubChem CID:	78686201
Reduced:	N4O6C19H32 (1)
Stoich.:	A4B6C19D32 (1)
Weight, g/mol:	382.085098
ΔH_f, kcal/mol:	-316.39
Dipole, Da:	1.77
IP(EA), eV:	-9.96(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(1-cyanocyclohexyl)-methylamino]-1-oxopropan-2-yl] 2,4-dichlorobenzoate

Drug info:

PubChemData

Smile

CC(C)CCC1(C(=O)N(C(=O)N1)CC(=O)OC(C)C(=O)NC(=O)NC(C)(C)C)C

DOS

IR

Vibrations