Geometry & MOs

Info

ID:	420775
PubChem CID:	135114796
Reduced:	NSO2C18H27 (1)
Stoich.:	ABC2D18E27 (1)
Weight, g/mol:	287.199762
ΔH_f, kcal/mol:	-90.26
Dipole, Da:	3.86
IP(EA), eV:	-8.71(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-[methyl-[(3-methyl-1H-indol-2-yl)methyl]amino]acetamide

Drug info:

PubChemData

Smile

CN(CC1(CCCC1)CO)C(=O)CCSCC2=CC=CC=C2

DOS

IR

Vibrations