Geometry & MOs

Info

ID:	200709
PubChem CID:	79430710
Reduced:	NSC19H27 (1)
Stoich.:	ABC19D27 (1)
Weight, g/mol:	289.240565
ΔH_f, kcal/mol:	11.0
Dipole, Da:	1.23
IP(EA), eV:	-8.72(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-(4-methylphenyl)-4-(oxolan-2-yl)butan-1-amine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(CCC2=CSC=C2)CNC(C)(C)C

DOS

IR

Vibrations