Geometry & MOs

Info

ID:	266616
PubChem CID:	103575702
Reduced:	BrOSN2C10H13 (1)
Stoich.:	ABCD2E10F13 (1)
Weight, g/mol:	224.188863
ΔH_f, kcal/mol:	-16.22
Dipole, Da:	3.53
IP(EA), eV:	-9.35(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-amino-4-methylpyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone

Drug info:

PubChemData

Smile

CC1CN(CC1N)C(=O)C2=C(C=CS2)Br

DOS

IR

Vibrations