Geometry & MOs

Info

ID:	290698
PubChem CID:	109817149
Reduced:	ON6C16H28 (1)
Stoich.:	AB6C16D28 (1)
Weight, g/mol:	386.268176
ΔH_f, kcal/mol:	-10.94
Dipole, Da:	3.44
IP(EA), eV:	-8.81(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[1-(3-methoxyphenyl)cyclopentyl]methyl]-2-methyl-3-(1-propanoylpyrrolidin-3-yl)guanidine

Drug info:

PubChemData

Smile

CCC(=O)N1CCC(C1)NC(=NCCN2C=C(C=N2)C)NCC

DOS

IR

Vibrations