Geometry & MOs

Info

ID:	290642
PubChem CID:	109801749
Reduced:	IO2N4C19H31 (1)
Stoich.:	AB2C4D19E31 (1)
Weight, g/mol:	359.268511
ΔH_f, kcal/mol:	-71.76
Dipole, Da:	5.59
IP(EA), eV:	-9.13(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-(dimethylamino)phenyl]methyl]-1-ethyl-3-[1-(2-methylpropanoyl)pyrrolidin-3-yl]guanidine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCCNC(=NC)NC2CCN(C2)C(=O)C(C)C.I

DOS

IR

Vibrations