Geometry & MOs

Info

ID:	204549
PubChem CID:	79981300
Reduced:	BrNSC10H16 (1)
Stoich.:	ABCD10E16 (1)
Weight, g/mol:	217.146664
ΔH_f, kcal/mol:	8.29
Dipole, Da:	3.46
IP(EA), eV:	-8.86(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylamino)-2-(2-cyclopropylphenyl)ethanol

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)CNCC(C)C)Br

DOS

IR

Vibrations