Geometry & MOs

Info

ID:	291283
PubChem CID:	111978438
Reduced:	ON4C23H38 (1)
Stoich.:	AB4C23D38 (1)
Weight, g/mol:	389.12151
ΔH_f, kcal/mol:	-37.02
Dipole, Da:	4.73
IP(EA), eV:	-8.81(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(4-bromophenyl)methyl]-N-ethyl-3-(1-methylpyrazol-4-yl)pyrrolidine-1-carboximidamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)CNC(=NC)NC2CCN(CC2)CC3CCOC3

DOS

IR

Vibrations