Geometry & MOs

Info

ID:	289380
PubChem CID:	104348384
Reduced:	N3O3C15H23 (1)
Stoich.:	A3B3C15D23 (1)
Weight, g/mol:	361.04596
ΔH_f, kcal/mol:	-113.74
Dipole, Da:	3.03
IP(EA), eV:	-7.96(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[2-amino-1-(4-bromothiophen-2-yl)propyl]pyrrolidin-3-yl]carbamate

Drug info:

PubChemData

Smile

COC(=O)NC1CCN(C1)CCCOC2=CC=C(C=C2)N

DOS

IR

Vibrations