Geometry & MOs

Info

ID:	200711
PubChem CID:	79430712
Reduced:	NSO2C17H29 (1)
Stoich.:	ABC2D17E29 (1)
Weight, g/mol:	365.08128
ΔH_f, kcal/mol:	-110.33
Dipole, Da:	6.31
IP(EA), eV:	-8.65(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromophenyl)-N-tert-butyl-4-thiophen-3-ylbutan-1-amine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(CCCS(=O)(=O)C)CNC(C)(C)C

DOS

IR

Vibrations