Geometry & MOs

Info

ID:	290707
PubChem CID:	109817197
Reduced:	ON2C10H19 (2)
Stoich.:	AB2C10D19 (2)
Weight, g/mol:	355.237211
ΔH_f, kcal/mol:	-115.77
Dipole, Da:	4.88
IP(EA), eV:	-8.94(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[3-(2,5-dihydropyrrol-1-yl)phenyl]methyl]-2-methyl-3-(1-propanoylpyrrolidin-3-yl)guanidine

Drug info:

PubChemData

Smile

CCC(=O)N1CCC(C1)NC(=NCC2CCCOC2C(C)(C)C)NCC

DOS

IR

Vibrations