Geometry & MOs

Info

ID:	431899
PubChem CID:	135172020
Reduced:	ClSO3N4C19H25 (1)
Stoich.:	ABC3D4E19F25 (1)
Weight, g/mol:	199.193614
ΔH_f, kcal/mol:	-63.18
Dipole, Da:	2.69
IP(EA), eV:	-9.4(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylpropyl)-N-propan-2-yloxan-4-amine

Drug info:

PubChemData

Smile

CC(C)CN(C1COC1)C2=C(C=C(C=C2)C(C)CC(=O)O)NC3=NC(=NS3)Cl

DOS

IR

Vibrations