Geometry & MOs

Info

ID:	158695
PubChem CID:	56465029
Reduced:	SN2O2C20H26 (1)
Stoich.:	AB2C2D20E26 (1)
Weight, g/mol:	370.07145
ΔH_f, kcal/mol:	-66.61
Dipole, Da:	2.29
IP(EA), eV:	-8.73(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)sulfanyl-N-[2-[cyclopropyl(methyl)amino]propyl]propanamide

Drug info:

PubChemData

Smile

CCOC1=CC2=C(CCN(C2)C(=O)C3=C(N=C(S3)CC(C)C)C)C=C1

DOS

IR

Vibrations